#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1d s VAL 19 N 0.00 5.11 0.00 5.09 -7.23 -1.26 -5.02 120.40 117.09 1p1d s VAL 19 Ca 0.00 -0.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.92 1p1d s VAL 19 Cb 0.00 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.33 1p1d s VAL 19 CO 0.00 0.02 0.00 0.55 -0.31 0.00 0.00 175.10 175.36 1p1d n VAL 20 N 5.07 0.00 -3.72 1.32 3.14 -1.26 -5.08 118.33 117.81 1p1d n VAL 20 Ca -0.13 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 60.90 1p1d n VAL 20 Cb 0.50 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.20 1p1d n VAL 20 CO 0.00 0.00 0.00 -1.38 -6.46 0.00 0.00 176.83 168.99 1p1d s HIS 21 N -2.00 3.42 1.11 1.45 -3.43 -1.26 -5.00 115.29 109.58 1p1d s HIS 21 Ca 0.00 0.36 -0.19 0.00 -0.80 0.00 0.00 55.06 54.43 1p1d s HIS 21 Cb 0.00 -2.17 0.09 0.00 -1.43 0.00 0.00 32.58 29.07 1p1d s HIS 21 CO 0.00 0.30 -0.10 0.25 -2.00 0.00 0.00 174.74 173.19 1p1d n THR 22 N 3.48 0.00 -3.69 -5.38 -2.24 -1.26 -4.51 114.28 100.68 1p1d n THR 22 Ca -0.16 -0.24 -0.08 0.00 -2.27 0.00 0.00 64.05 61.31 1p1d n THR 22 Cb 0.52 -0.54 -0.02 0.00 -2.10 0.00 0.00 70.33 68.19 1p1d n THR 22 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1p1d s GLU 23 N -3.33 1.45 0.14 -0.78 2.02 -0.90 -4.85 118.70 112.44 1p1d s GLU 23 Ca 0.52 -0.72 0.11 0.00 0.02 0.00 0.00 54.97 54.90 1p1d s GLU 23 Cb -0.09 0.55 -0.04 0.00 0.10 0.00 0.00 34.13 34.65 1p1d s GLU 23 CO 0.62 -0.65 -0.26 0.95 0.02 0.00 0.00 175.26 175.94 1p1d s THR 24 N -3.68 2.24 0.12 3.63 -4.23 -1.26 -1.37 115.64 111.09 1p1d s THR 24 Ca 0.08 -1.81 0.02 0.00 -1.18 0.00 0.00 61.69 58.80 1p1d s THR 24 Cb -0.03 -2.00 -0.01 0.00 1.34 0.00 0.00 72.50 71.80 1p1d s THR 24 CO -0.01 0.03 0.08 1.07 -0.54 0.00 0.00 174.62 175.25 1p1d n THR 25 N 0.77 0.00 -4.47 3.99 5.66 0.42 -4.99 114.28 115.66 1p1d n THR 25 Ca -0.17 -0.81 -0.25 0.00 -3.05 0.00 0.00 64.05 59.77 1p1d n THR 25 Cb 0.54 0.37 -0.10 0.00 -1.55 0.00 0.00 70.33 69.59 1p1d n THR 25 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1p1d s GLU 26 N -2.48 1.84 0.04 1.09 1.03 -1.26 -1.82 118.70 117.14 1p1d s GLU 26 Ca 0.11 -1.82 0.02 0.00 0.03 0.00 0.00 54.97 53.31 1p1d s GLU 26 Cb 0.01 -1.79 -0.02 0.00 -0.80 0.00 0.00 34.13 31.52 1p1d s GLU 26 CO 0.08 0.21 -0.08 0.08 -1.33 0.00 0.00 175.26 174.22 1p1d s VAL 27 N -2.55 0.60 -0.22 1.83 1.01 0.13 -4.76 120.40 116.43 1p1d s VAL 27 Ca 0.32 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1p1d s VAL 27 Cb -0.01 -0.64 0.06 0.00 0.00 0.00 0.00 36.38 35.79 1p1d s VAL 27 CO 0.17 -0.33 -0.01 -0.69 0.00 0.00 0.00 175.10 174.23 1p1d s VAL 28 N -1.29 1.09 -0.24 2.92 1.01 -1.26 -1.94 120.40 120.68 1p1d s VAL 28 Ca -0.08 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 1p1d s VAL 28 Cb -0.10 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.82 1p1d s VAL 28 CO 0.01 -0.16 -0.03 -0.76 0.00 0.00 0.00 175.10 174.15 1p1d s LEU 29 N 1.60 3.10 0.30 3.92 1.43 0.55 -4.85 118.68 124.72 1p1d s LEU 29 Ca -0.03 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1p1d s LEU 29 Cb -0.18 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1p1d s LEU 29 CO -0.07 -0.07 0.27 0.42 0.23 0.00 0.00 176.35 177.13 1p1d s THR 30 N 1.45 4.01 -0.40 5.49 -4.23 -1.26 0.14 115.64 120.84 1p1d s THR 30 Ca 0.04 -1.34 -0.12 0.00 -1.18 0.00 0.00 61.69 59.09 1p1d s THR 30 Cb -0.15 -3.32 0.04 0.00 1.34 0.00 0.00 72.50 70.41 1p1d s THR 30 CO -0.03 -0.25 0.25 0.00 -0.54 0.00 0.00 174.62 174.06 1p1d s ALA 31 N -2.21 3.36 0.45 3.99 0.00 -0.88 -4.54 121.76 121.92 1p1d s ALA 31 Ca 0.38 -1.80 -0.21 0.00 0.00 0.00 0.00 51.96 50.33 1p1d s ALA 31 Cb -0.07 -2.72 -0.10 0.00 0.00 0.00 0.00 23.12 20.23 1p1d s ALA 31 CO 0.26 -1.47 0.98 0.34 0.00 0.00 0.00 175.76 175.87 1p1d s ASP 32 N 1.74 6.74 0.00 0.00 2.15 -0.77 -4.77 116.67 121.76 1p1d s ASP 32 Ca 0.03 1.76 0.16 0.00 0.43 0.00 0.00 52.55 54.93 1p1d s ASP 32 Cb -0.20 -2.55 0.94 0.00 -0.30 0.00 0.00 42.92 40.81 1p1d s ASP 32 CO 0.07 -0.50 1.46 -0.81 -0.17 0.00 0.00 175.17 175.22 1p1d n PRO 33 N -0.77 0.79 -0.02 4.34 -0.04 -1.26 -0.38 135.00 137.65 1p1d n PRO 33 Ca 0.08 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.50 1p1d n PRO 33 Cb 0.54 -1.31 -0.02 0.00 -0.04 0.00 0.00 33.50 32.66 1p1d n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1p1d n VAL 34 N -0.81 0.24 0.00 0.52 0.31 -1.26 -4.88 118.33 112.45 1p1d n VAL 34 Ca 0.12 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1p1d n VAL 34 Cb 0.05 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 1p1d n VAL 34 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1p1d n THR 35 N -2.82 0.00 0.00 2.52 -2.24 -1.24 -5.05 114.28 105.45 1p1d n THR 35 Ca -0.08 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1p1d n THR 35 Cb 0.57 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1p1d n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p1d n GLY 36 N 0.80 0.76 2.65 3.38 0.00 0.48 -4.29 105.19 108.98 1p1d n GLY 36 Ca 0.00 0.60 -0.24 0.00 0.00 0.00 0.00 46.02 46.38 1p1d n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p1d s PHE 37 N 0.00 0.28 -0.37 1.61 0.40 -1.26 -1.84 117.98 116.80 1p1d s PHE 37 Ca 0.00 -0.20 0.05 0.00 -0.60 0.00 0.00 56.93 56.18 1p1d s PHE 37 Cb 0.00 -0.67 0.47 0.00 0.51 0.00 0.00 43.02 43.32 1p1d s PHE 37 CO 0.00 -0.42 1.48 0.41 0.70 0.00 0.00 175.22 177.40 1p1d n GLY 38 N 5.25 3.17 3.67 4.36 0.00 -1.26 -4.91 105.19 115.48 1p1d n GLY 38 Ca -0.06 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.92 1p1d n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 39 N -2.12 5.16 -0.61 -0.61 1.09 -1.26 -0.30 121.20 122.55 1p1d s ILE 39 Ca 0.36 0.83 -0.17 0.00 -1.10 0.00 0.00 60.65 60.57 1p1d s ILE 39 Cb 0.29 -3.79 0.13 0.00 -1.06 0.00 0.00 42.46 38.04 1p1d s ILE 39 CO 0.08 0.22 0.62 -1.10 -0.10 0.00 0.00 174.94 174.67 1p1d s GLN 40 N 1.42 3.11 0.24 2.79 -0.21 0.13 -4.98 119.66 122.15 1p1d s GLN 40 Ca 0.22 -1.68 0.00 0.00 0.02 0.00 0.00 55.36 53.93 1p1d s GLN 40 Cb -0.15 -4.33 -0.04 0.00 1.00 0.00 0.00 33.01 29.50 1p1d s GLN 40 CO 0.09 -1.41 0.42 -1.17 -2.12 0.00 0.00 175.29 171.09 1p1d s LEU 41 N 1.82 4.20 0.27 2.90 2.96 -1.26 0.14 118.68 129.70 1p1d s LEU 41 Ca 0.09 0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.37 1p1d s LEU 41 Cb -0.25 -3.14 -0.05 0.00 0.50 0.00 0.00 46.19 43.24 1p1d s LEU 41 CO 0.02 -0.10 0.07 -1.10 -1.32 0.00 0.00 176.35 173.93 1p1d s GLN 42 N -3.63 1.45 -0.38 1.98 -0.21 -0.07 -4.86 119.66 113.94 1p1d s GLN 42 Ca 0.38 -1.78 0.12 0.00 0.02 0.00 0.00 55.36 54.10 1p1d s GLN 42 Cb -0.10 -0.45 0.37 0.00 1.00 0.00 0.00 33.01 33.83 1p1d s GLN 42 CO 0.30 -0.24 0.94 0.41 -2.12 0.00 0.00 175.29 174.58 1p1d n GLY 43 N -0.50 2.20 2.73 3.09 0.00 -1.26 -2.45 105.19 108.99 1p1d n GLY 43 Ca -0.01 -1.04 -0.06 0.00 0.00 0.00 0.00 46.02 44.90 1p1d n GLY 43 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p1d n SER 44 N 0.12 -3.17 0.00 1.61 7.64 -1.26 -4.77 113.62 113.79 1p1d n SER 44 Ca 0.14 -2.90 0.00 0.00 1.01 0.00 0.00 58.87 57.12 1p1d n SER 44 Cb 0.73 1.56 0.00 0.00 -1.01 0.00 0.00 64.21 65.49 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1p1d n VAL 45 N 2.85 0.00 -0.25 0.44 0.31 -1.26 -4.60 118.33 115.81 1p1d n VAL 45 Ca 0.18 0.35 0.12 0.00 -0.01 0.00 0.00 64.34 64.99 1p1d n VAL 45 Cb 0.56 -1.33 0.24 0.00 -0.91 0.00 0.00 33.84 32.40 1p1d n VAL 45 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 1p1d n PHE 46 N -2.16 0.51 -3.40 3.52 -1.74 -1.26 -4.83 117.46 108.10 1p1d n PHE 46 Ca 0.00 0.89 -0.17 0.00 -0.56 0.00 0.00 57.45 57.61 1p1d n PHE 46 Cb 0.00 -1.08 0.01 0.00 1.52 0.00 0.00 39.48 39.93 1p1d n PHE 46 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1p1d n ALA 47 N -3.21 -2.66 0.00 1.98 0.00 -1.26 -4.98 120.51 110.38 1p1d n ALA 47 Ca 0.18 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1p1d n ALA 47 Cb 0.60 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1p1d n ALA 47 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1p1d n THR 48 N -1.72 0.00 -0.76 0.00 5.66 -1.26 -5.16 114.28 111.04 1p1d n THR 48 Ca -0.13 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 60.97 1p1d n THR 48 Cb 0.60 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.36 1p1d n THR 48 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1p1d n GLU 49 N 0.00 -1.48 0.00 1.09 0.28 -1.26 -4.87 120.64 114.40 1p1d n GLU 49 Ca 0.00 0.99 0.00 0.00 -0.16 0.00 0.00 57.16 57.99 1p1d n GLU 49 Cb 0.00 -1.83 0.00 0.00 1.43 0.00 0.00 31.44 31.04 1p1d n GLU 49 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1p1d n THR 50 N -2.49 0.00 0.00 3.84 5.66 -1.26 -4.98 114.28 115.06 1p1d n THR 50 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1p1d n THR 50 Cb 0.59 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 1p1d n THR 50 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1p1d n LEU 51 N 0.00 0.00 -1.13 1.09 4.77 -1.26 -4.99 117.00 115.48 1p1d n LEU 51 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 1p1d n LEU 51 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1p1d n LEU 51 CO 0.00 0.00 -0.09 -0.24 -1.33 0.00 0.00 177.39 175.73 1p1d n SER 52 N 0.00 -3.11 -4.61 -1.43 2.88 -1.23 -4.85 113.62 101.27 1p1d n SER 52 Ca 0.00 0.24 -0.43 0.00 -1.33 0.00 0.00 58.87 57.36 1p1d n SER 52 Cb 0.00 -2.82 -0.03 0.00 -0.75 0.00 0.00 64.21 60.62 1p1d n SER 52 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1p1d s SER 53 N -1.85 5.95 0.37 -3.46 0.15 -1.26 -4.75 113.70 108.84 1p1d s SER 53 Ca 0.00 1.53 -0.24 0.00 0.70 0.00 0.00 55.95 57.94 1p1d s SER 53 Cb 0.00 -2.52 -0.10 0.00 -1.71 0.00 0.00 66.02 61.69 1p1d s SER 53 CO 0.00 -1.62 0.98 -2.16 1.20 0.00 0.00 173.24 171.64 1p1d s PRO 54 N 5.50 4.36 -0.58 5.44 0.04 -1.26 -4.04 135.00 144.47 1p1d s PRO 54 Ca 0.82 1.35 -0.33 0.00 0.04 0.00 0.00 61.00 62.88 1p1d s PRO 54 Cb -0.26 -2.58 -0.14 0.00 0.04 0.00 0.00 34.50 31.57 1p1d s PRO 54 CO 0.33 0.07 2.38 -0.35 0.04 0.00 0.00 177.00 179.47 1p1d n PRO 55 N 0.08 0.65 -4.00 0.56 -0.04 -1.26 -4.81 135.00 126.18 1p1d n PRO 55 Ca 0.04 0.11 -0.34 0.00 -0.04 0.00 0.00 63.50 63.28 1p1d n PRO 55 Cb 0.51 -2.31 -0.15 0.00 -0.04 0.00 0.00 33.50 31.51 1p1d n PRO 55 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1p1d s LEU 56 N 8.77 3.43 0.86 1.53 2.34 -1.03 -4.18 118.68 130.40 1p1d s LEU 56 Ca 1.16 -1.19 -0.12 0.00 0.06 0.00 0.00 54.13 54.04 1p1d s LEU 56 Cb -0.89 -1.62 0.11 0.00 -0.56 0.00 0.00 46.19 43.23 1p1d s LEU 56 CO 0.46 -0.18 1.16 -0.38 -1.06 0.00 0.00 176.35 176.34 1p1d n ILE 57 N 4.56 1.15 0.00 1.48 5.41 -1.26 -0.89 119.36 129.81 1p1d n ILE 57 Ca -0.15 -0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.48 1p1d n ILE 57 Cb 0.44 -1.10 0.00 0.00 -0.71 0.00 0.00 39.64 38.27 1p1d n ILE 57 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1p1d n SER 58 N -3.62 2.60 -3.62 4.38 2.88 0.36 -0.20 113.62 116.41 1p1d n SER 58 Ca 0.13 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.63 1p1d n SER 58 Cb 0.51 0.15 -0.06 0.00 -0.75 0.00 0.00 64.21 64.06 1p1d n SER 58 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1p1d s TYR 59 N -1.58 -0.91 0.47 0.66 5.04 -1.07 -4.75 117.35 115.21 1p1d s TYR 59 Ca 0.00 1.75 0.04 0.00 -2.44 0.00 0.00 57.07 56.42 1p1d s TYR 59 Cb 0.00 0.54 0.02 0.00 0.35 0.00 0.00 41.96 42.87 1p1d s TYR 59 CO 0.00 -0.45 0.66 0.42 -1.34 0.00 0.00 175.55 174.84 1p1d s ILE 60 N 1.78 3.15 -0.03 3.14 1.01 -1.26 0.19 121.20 129.18 1p1d s ILE 60 Ca -0.08 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.81 1p1d s ILE 60 Cb -0.06 -3.12 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 1p1d s ILE 60 CO -0.18 -0.07 -0.11 -0.70 0.00 0.00 0.00 174.94 173.88 1p1d s GLU 61 N -4.53 2.52 -0.71 2.79 -6.30 0.59 -4.93 118.70 108.13 1p1d s GLU 61 Ca 0.54 -0.70 -0.12 0.00 -2.50 0.00 0.00 54.97 52.19 1p1d s GLU 61 Cb -0.10 -2.44 -0.10 0.00 0.00 0.00 0.00 34.13 31.49 1p1d s GLU 61 CO 0.36 0.62 1.89 0.00 0.02 0.00 0.00 175.26 178.15 1p1d n ALA 62 N 2.03 3.61 0.00 6.30 0.00 -1.26 -2.58 120.51 128.60 1p1d n ALA 62 Ca -0.17 -2.25 0.00 0.00 0.00 0.00 0.00 53.44 51.02 1p1d n ALA 62 Cb 0.52 -3.20 0.00 0.00 0.00 0.00 0.00 19.45 16.78 1p1d n ALA 62 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1p1d n ASP 63 N 5.65 0.00 -4.00 0.00 5.68 -1.26 -5.17 116.55 117.46 1p1d n ASP 63 Ca 0.41 0.00 -0.18 0.00 -0.50 0.00 0.00 54.79 54.53 1p1d n ASP 63 Cb 0.22 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.06 1p1d n ASP 63 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1p1d s SER 64 N 0.00 0.91 0.17 -1.12 0.15 -1.07 -4.64 113.70 108.10 1p1d s SER 64 Ca 0.00 -0.14 0.14 0.00 0.70 0.00 0.00 55.95 56.65 1p1d s SER 64 Cb 0.00 -0.10 0.71 0.00 -1.71 0.00 0.00 66.02 64.92 1p1d s SER 64 CO 0.00 0.09 1.44 -0.81 1.20 0.00 0.00 173.24 175.17 1p1d n PRO 65 N 2.90 0.09 0.05 5.44 -0.04 -1.26 -1.55 135.00 140.62 1p1d n PRO 65 Ca -0.13 0.51 -0.08 0.00 -0.04 0.00 0.00 63.50 63.75 1p1d n PRO 65 Cb 0.57 -1.75 -0.06 0.00 -0.04 0.00 0.00 33.50 32.23 1p1d n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p1d h ALA 66 N 2.11 -0.22 0.00 0.55 0.00 -1.87 0.59 119.26 120.42 1p1d h ALA 66 Ca 0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 1p1d h ALA 66 Cb 0.10 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1p1d h ALA 66 CO 0.00 -0.25 -0.61 1.49 0.00 0.00 0.00 179.25 179.88 1p1d h GLU 67 N -0.96 0.00 0.00 0.00 4.57 -1.85 -2.85 114.58 113.49 1p1d h GLU 67 Ca -0.02 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.08 1p1d h GLU 67 Cb 0.45 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 1p1d h GLU 67 CO 0.04 0.61 -0.38 0.00 -1.18 0.00 0.00 179.01 178.10 1p1d h ARG 68 N 0.00 0.00 -0.73 1.92 -0.00 -1.38 -3.31 114.38 110.88 1p1d h ARG 68 Ca -0.01 0.00 0.13 0.00 -0.50 0.00 0.00 59.98 59.61 1p1d h ARG 68 Cb 1.09 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 30.92 1p1d h ARG 68 CO 0.08 0.38 -0.28 0.00 0.00 0.00 0.00 179.97 180.14 1p1d n GLY 70 N -1.47 1.76 2.20 0.00 0.00 -1.25 -4.21 105.19 102.22 1p1d n GLY 70 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.07 1p1d n GLY 70 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p1d n VAL 71 N -0.18 0.06 -5.13 1.61 0.24 -1.26 -4.23 118.33 109.44 1p1d n VAL 71 Ca 0.00 -0.83 -0.29 0.00 -2.04 0.00 0.00 64.34 61.19 1p1d n VAL 71 Cb 0.00 0.88 -0.16 0.00 -1.47 0.00 0.00 33.84 33.09 1p1d n VAL 71 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1p1d s LEU 72 N -2.92 2.05 0.19 1.34 2.01 -1.26 -4.95 118.68 115.14 1p1d s LEU 72 Ca 0.08 -0.42 -0.06 0.00 0.01 0.00 0.00 54.13 53.74 1p1d s LEU 72 Cb 0.32 -1.18 -0.02 0.00 0.01 0.00 0.00 46.19 45.32 1p1d s LEU 72 CO -0.09 0.28 0.25 -1.10 1.01 0.00 0.00 176.35 176.69 1p1d s GLN 73 N -0.57 1.21 0.09 1.70 -1.52 -1.26 -4.90 119.66 114.42 1p1d s GLN 73 Ca 0.09 -1.36 -0.31 0.00 -1.95 0.00 0.00 55.36 51.83 1p1d s GLN 73 Cb -0.09 0.35 -0.08 0.00 -0.22 0.00 0.00 33.01 32.96 1p1d s GLN 73 CO -0.01 -0.43 1.58 0.42 -0.25 0.00 0.00 175.29 176.60 1p1d s ILE 74 N -4.04 3.01 -0.71 1.08 -1.09 -1.26 -3.09 121.20 115.10 1p1d s ILE 74 Ca 0.25 0.58 -0.00 0.00 -2.23 0.00 0.00 60.65 59.25 1p1d s ILE 74 Cb 0.04 -3.37 -0.00 0.00 -1.58 0.00 0.00 42.46 37.55 1p1d s ILE 74 CO 0.05 0.02 0.59 0.61 -1.23 0.00 0.00 174.94 174.98 1p1d n GLY 75 N 3.85 -0.03 3.56 6.18 0.00 0.72 -4.93 105.19 114.54 1p1d n GLY 75 Ca 0.15 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1p1d n GLY 75 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p1d s ASP 76 N -3.80 6.16 0.82 1.61 1.11 -1.18 -4.73 116.67 116.67 1p1d s ASP 76 Ca 0.00 -0.07 -0.14 0.00 0.18 0.00 0.00 52.55 52.52 1p1d s ASP 76 Cb -0.00 -2.55 0.01 0.00 1.07 0.00 0.00 42.92 41.45 1p1d s ASP 76 CO 0.43 -1.75 0.59 -1.14 1.18 0.00 0.00 175.17 174.48 1p1d n ARG 77 N 8.95 0.07 -3.82 8.23 3.00 -1.26 -4.38 116.66 127.46 1p1d n ARG 77 Ca 0.08 0.08 -0.10 0.00 -0.00 0.00 0.00 57.85 57.91 1p1d n ARG 77 Cb 0.49 -1.94 -0.07 0.00 0.00 0.00 0.00 32.46 30.94 1p1d n ARG 77 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1p1d s VAL 78 N -2.12 0.12 0.00 5.15 1.01 -1.26 -4.52 120.40 118.77 1p1d s VAL 78 Ca 0.64 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1p1d s VAL 78 Cb -0.29 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 34.97 1p1d s VAL 78 CO 0.60 -0.53 0.00 0.80 0.00 0.00 0.00 175.10 175.97 1p1d n MET 79 N 0.27 0.00 -3.75 2.72 1.56 -0.45 -4.77 117.12 112.70 1p1d n MET 79 Ca -0.17 0.00 -0.12 0.00 -0.27 0.00 0.00 57.70 57.14 1p1d n MET 79 Cb 0.61 -0.80 -0.11 0.00 2.15 0.00 0.00 33.22 35.06 1p1d n MET 79 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1p1d s ALA 80 N -1.78 -0.77 -0.24 -5.12 0.00 -1.25 -3.58 121.76 109.02 1p1d s ALA 80 Ca 0.00 0.98 0.02 0.00 0.00 0.00 0.00 51.96 52.96 1p1d s ALA 80 Cb 0.00 -0.58 0.05 0.00 0.00 0.00 0.00 23.12 22.59 1p1d s ALA 80 CO 0.00 -0.17 -0.12 0.42 0.00 0.00 0.00 175.76 175.89 1p1d s ILE 81 N 0.51 2.02 -2.12 0.00 1.01 -0.48 -1.53 121.20 120.60 1p1d s ILE 81 Ca -0.03 -1.39 0.00 0.00 0.00 0.00 0.00 60.65 59.23 1p1d s ILE 81 Cb -0.04 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.34 1p1d s ILE 81 CO -0.03 0.09 0.00 0.59 0.00 0.00 0.00 174.94 175.59 1p1d n ASN 82 N 4.52 -5.38 0.00 3.58 3.02 0.35 -0.83 115.26 120.52 1p1d n ASN 82 Ca -0.15 0.46 0.00 0.00 -0.03 0.00 0.00 54.58 54.86 1p1d n ASN 82 Cb 0.44 -4.74 0.00 0.00 -0.61 0.00 0.00 39.78 34.87 1p1d n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p1d n GLY 83 N -0.42 3.14 3.66 7.41 0.00 -1.26 -5.05 105.19 112.67 1p1d n GLY 83 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1p1d n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 84 N -2.80 4.29 0.00 -0.61 1.01 -0.01 -5.02 121.20 118.06 1p1d s ILE 84 Ca 0.00 1.56 0.00 0.00 0.00 0.00 0.00 60.65 62.21 1p1d s ILE 84 Cb 0.00 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.45 1p1d s ILE 84 CO 0.00 -0.15 0.00 -2.65 0.00 0.00 0.00 174.94 172.14 1p1d n PRO 85 N 6.63 -0.42 0.00 2.79 -0.02 -1.26 -1.38 135.00 141.34 1p1d n PRO 85 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1p1d n PRO 85 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.93 1p1d n PRO 85 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1p1d n THR 86 N -2.23 0.00 0.45 3.45 -2.24 -1.24 -4.59 114.28 107.88 1p1d n THR 86 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1p1d n THR 86 Cb 0.00 0.00 0.34 0.00 -2.10 0.00 0.00 70.33 68.57 1p1d n THR 86 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1p1d n GLU 87 N -1.13 0.05 -2.29 -0.78 2.13 -1.26 -2.88 120.64 114.48 1p1d n GLU 87 Ca 0.00 0.31 -0.27 0.00 0.66 0.00 0.00 57.16 57.85 1p1d n GLU 87 Cb 0.00 -1.60 0.01 0.00 0.27 0.00 0.00 31.44 30.12 1p1d n GLU 87 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1p1d n ASP 88 N -1.69 5.06 -3.76 4.31 5.75 -1.26 -4.82 116.55 120.15 1p1d n ASP 88 Ca 0.03 -3.74 0.02 0.00 -0.01 0.00 0.00 54.79 51.09 1p1d n ASP 88 Cb 0.18 -0.49 0.01 0.00 -1.03 0.00 0.00 41.12 39.79 1p1d n ASP 88 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1p1d s SER 89 N -3.32 0.01 0.77 -1.12 0.01 -1.14 -5.10 113.70 103.81 1p1d s SER 89 Ca 0.50 -0.28 -0.11 0.00 1.31 0.00 0.00 55.95 57.36 1p1d s SER 89 Cb 0.41 0.20 0.05 0.00 0.21 0.00 0.00 66.02 66.89 1p1d s SER 89 CO -0.14 -0.40 1.09 0.28 0.41 0.00 0.00 173.24 174.48 1p1d s THR 90 N -2.03 3.26 0.25 1.44 -1.32 -1.26 -3.54 115.64 112.44 1p1d s THR 90 Ca 0.29 0.41 0.09 0.00 -1.21 0.00 0.00 61.69 61.27 1p1d s THR 90 Cb -0.01 -3.21 -0.06 0.00 -1.51 0.00 0.00 72.50 67.72 1p1d s THR 90 CO 0.00 -0.53 1.56 2.19 -2.21 0.00 0.00 174.62 175.63 1p1d h PHE 91 N -0.96 0.04 -0.64 9.09 -0.00 -1.86 -3.16 116.94 119.46 1p1d h PHE 91 Ca -0.46 -0.02 0.15 0.00 -0.00 0.00 0.00 57.97 57.64 1p1d h PHE 91 Cb 1.26 -0.01 -0.03 0.00 -0.00 0.00 0.00 35.95 37.17 1p1d h PHE 91 CO 0.49 0.69 0.44 0.93 -0.00 0.00 0.00 178.31 180.86 1p1d h GLU 92 N 0.02 0.19 -0.44 6.09 4.39 -1.90 0.19 114.58 123.10 1p1d h GLU 92 Ca -0.01 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 1p1d h GLU 92 Cb 1.20 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.79 1p1d h GLU 92 CO 0.09 0.12 -0.13 1.05 -1.16 0.00 0.00 179.01 178.98 1p1d h GLU 93 N 0.19 0.82 0.00 2.33 -0.00 -1.94 0.76 114.58 116.74 1p1d h GLU 93 Ca 0.31 -0.29 -0.12 0.00 -0.00 0.00 0.00 59.36 59.26 1p1d h GLU 93 Cb 0.94 -0.06 -0.02 0.00 -0.00 0.00 0.00 28.75 29.61 1p1d h GLU 93 CO -0.05 0.91 -0.56 0.00 -0.00 0.00 0.00 179.01 179.30 1p1d h ALA 94 N 1.12 1.01 0.05 1.06 0.00 -1.15 -1.32 119.26 120.03 1p1d h ALA 94 Ca 0.12 -0.51 -0.26 0.00 0.00 0.00 0.00 54.91 54.26 1p1d h ALA 94 Cb 0.63 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.35 1p1d h ALA 94 CO 0.04 0.70 -1.09 -0.91 0.00 0.00 0.00 179.25 178.00 1p1d h ASN 95 N 0.00 0.74 0.27 0.00 -0.26 -0.94 -2.37 115.58 113.02 1p1d h ASN 95 Ca -0.01 -0.63 -0.20 0.00 -0.56 0.00 0.00 56.30 54.90 1p1d h ASN 95 Cb 1.03 -0.23 -0.00 0.00 -1.06 0.00 0.00 38.32 38.06 1p1d h ASN 95 CO 0.07 1.44 -0.82 0.06 -1.06 0.00 0.00 177.43 177.13 1p1d h GLN 96 N 0.28 0.43 -0.19 0.81 -0.00 -0.77 -1.51 115.11 114.15 1p1d h GLN 96 Ca -0.13 -0.39 -0.08 0.00 -0.00 0.00 0.00 58.65 58.05 1p1d h GLN 96 Cb 1.75 0.09 -0.00 0.00 -0.00 0.00 0.00 27.48 29.32 1p1d h GLN 96 CO 0.20 1.04 -0.19 1.37 -0.00 0.00 0.00 178.83 181.25 1p1d h LEU 97 N 0.27 0.50 0.73 0.06 8.10 -1.31 -1.21 115.31 122.44 1p1d h LEU 97 Ca -0.05 -0.48 -0.04 0.00 0.11 0.00 0.00 57.88 57.42 1p1d h LEU 97 Cb 1.42 -0.14 0.01 0.00 -0.44 0.00 0.00 40.66 41.50 1p1d h LEU 97 CO 0.14 0.88 -0.35 -0.07 -4.11 0.00 0.00 178.44 174.93 1p1d h LEU 98 N 0.13 -0.82 -1.98 0.17 3.38 -1.47 0.98 115.31 115.70 1p1d h LEU 98 Ca 0.03 0.01 0.26 0.00 0.09 0.00 0.00 57.88 58.26 1p1d h LEU 98 Cb 0.74 0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.67 1p1d h LEU 98 CO 0.05 -0.48 0.65 0.08 0.09 0.00 0.00 178.44 178.84 1p1d h ARG 99 N -1.18 0.00 -0.55 1.13 -0.00 -1.36 0.71 114.38 113.13 1p1d h ARG 99 Ca -0.10 0.00 -0.35 0.00 -0.00 0.00 0.00 59.98 59.53 1p1d h ARG 99 Cb 0.77 0.00 -0.22 0.00 -0.00 0.00 0.00 29.97 30.52 1p1d h ARG 99 CO 0.16 0.00 -0.14 -3.47 -0.00 0.00 0.00 179.97 176.52 1p1d n ASP 100 N -4.19 3.86 -1.53 0.08 -0.08 -0.46 -4.58 116.55 109.64 1p1d n ASP 100 Ca 0.18 -3.79 0.08 0.00 -1.51 0.00 0.00 54.79 49.76 1p1d n ASP 100 Cb 0.97 -0.61 0.35 0.00 2.34 0.00 0.00 41.12 44.17 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1p1d n SER 101 N -0.99 4.90 -1.33 1.67 3.41 0.34 -4.33 113.62 117.29 1p1d n SER 101 Ca 0.41 -2.72 0.10 0.00 -0.26 0.00 0.00 58.87 56.40 1p1d n SER 101 Cb 0.97 -0.60 0.31 0.00 -0.26 0.00 0.00 64.21 64.63 1p1d n SER 101 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1p1d n SER 102 N 0.60 4.09 -0.02 4.04 3.41 -1.26 -4.17 113.62 120.31 1p1d n SER 102 Ca 0.25 -2.17 -0.13 0.00 -0.26 0.00 0.00 58.87 56.56 1p1d n SER 102 Cb 0.99 -0.49 -0.09 0.00 -0.26 0.00 0.00 64.21 64.36 1p1d n SER 102 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1p1d h ILE 103 N 3.87 1.35 -0.24 -1.33 2.04 -1.92 -3.04 117.51 118.24 1p1d h ILE 103 Ca 0.00 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.79 1p1d h ILE 103 Cb 1.12 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1p1d h ILE 103 CO 0.08 0.29 0.00 0.35 0.00 0.00 0.00 178.15 178.87 1p1d n THR 104 N -4.82 0.32 -1.92 -0.27 -2.24 -1.26 -4.90 114.28 99.18 1p1d n THR 104 Ca -0.08 -0.39 -0.17 0.00 -2.27 0.00 0.00 64.05 61.15 1p1d n THR 104 Cb 0.25 0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.73 1p1d n THR 104 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1p1d n SER 105 N 0.38 -4.62 -3.62 3.42 3.41 -1.15 -4.89 113.62 106.56 1p1d n SER 105 Ca 0.14 0.26 -0.07 0.00 -0.26 0.00 0.00 58.87 58.94 1p1d n SER 105 Cb 0.30 -4.03 -0.06 0.00 -0.26 0.00 0.00 64.21 60.17 1p1d n SER 105 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1p1d s LYS 106 N -4.17 0.35 -0.10 4.33 2.20 -1.26 -2.08 119.74 119.02 1p1d s LYS 106 Ca 0.00 0.20 -0.06 0.00 -0.36 0.00 0.00 55.97 55.76 1p1d s LYS 106 Cb 0.00 0.17 0.04 0.00 -1.51 0.00 0.00 37.83 36.53 1p1d s LYS 106 CO 0.00 -0.09 0.24 0.08 -0.36 0.00 0.00 175.35 175.22 1p1d s VAL 107 N -0.58 -0.03 -0.08 4.02 1.01 0.37 -4.90 120.40 120.21 1p1d s VAL 107 Ca 0.03 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 62.09 1p1d s VAL 107 Cb -0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 1p1d s VAL 107 CO -0.05 0.05 0.07 0.42 0.00 0.00 0.00 175.10 175.58 1p1d s THR 108 N 0.96 4.86 -0.00 3.92 -4.23 -1.26 -0.33 115.64 119.56 1p1d s THR 108 Ca -0.07 -0.11 0.01 0.00 -1.18 0.00 0.00 61.69 60.34 1p1d s THR 108 Cb -0.08 -3.11 -0.00 0.00 1.34 0.00 0.00 72.50 70.64 1p1d s THR 108 CO -0.06 0.55 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.77 1p1d s LEU 109 N -1.14 2.01 -0.33 4.79 1.02 -0.82 -0.49 118.68 123.72 1p1d s LEU 109 Ca 0.16 -0.07 -0.12 0.00 0.02 0.00 0.00 54.13 54.13 1p1d s LEU 109 Cb -0.12 -0.18 -0.02 0.00 0.02 0.00 0.00 46.19 45.90 1p1d s LEU 109 CO 0.06 0.04 0.21 -1.61 0.02 0.00 0.00 176.35 175.06 1p1d s GLU 110 N -0.10 3.47 0.33 1.70 0.41 -0.59 0.18 118.70 124.09 1p1d s GLU 110 Ca 0.01 -0.65 0.10 0.00 -0.41 0.00 0.00 54.97 54.02 1p1d s GLU 110 Cb -0.01 -3.71 -0.06 0.00 -1.78 0.00 0.00 34.13 28.57 1p1d s GLU 110 CO -0.00 -0.42 -0.05 0.96 -0.49 0.00 0.00 175.26 175.26 1p1d s ILE 111 N 1.69 2.56 -0.05 -1.63 -5.25 -0.76 -1.34 121.20 116.42 1p1d s ILE 111 Ca 0.06 -2.10 0.02 0.00 -0.99 0.00 0.00 60.65 57.64 1p1d s ILE 111 Cb -0.17 -2.68 0.01 0.00 2.95 0.00 0.00 42.46 42.57 1p1d s ILE 111 CO 0.09 -0.24 -0.10 -0.70 -1.79 0.00 0.00 174.94 172.19 1p1d s GLU 112 N -3.65 1.34 0.27 0.37 -6.30 -1.26 -0.43 118.70 109.04 1p1d s GLU 112 Ca 0.33 -0.34 0.00 0.00 -2.50 0.00 0.00 54.97 52.47 1p1d s GLU 112 Cb -0.01 -1.17 -0.03 0.00 0.00 0.00 0.00 34.13 32.93 1p1d s GLU 112 CO 0.18 0.04 0.28 -0.59 0.02 0.00 0.00 175.26 175.19 1p1d s PHE 113 N 0.56 1.27 -0.54 5.30 -0.12 -0.47 -4.88 117.98 119.10 1p1d s PHE 113 Ca -0.11 -1.40 -0.20 0.00 -0.05 0.00 0.00 56.93 55.18 1p1d s PHE 113 Cb -0.14 -0.45 0.06 0.00 -0.63 0.00 0.00 43.02 41.87 1p1d s PHE 113 CO 0.02 -0.84 0.70 0.34 -0.05 0.00 0.00 175.22 175.39 1p1d s ASP 114 N -3.23 6.23 0.52 1.98 -1.08 -1.26 -2.12 116.67 117.71 1p1d s ASP 114 Ca 0.36 -0.93 -0.23 0.00 -0.52 0.00 0.00 52.55 51.24 1p1d s ASP 114 Cb 0.03 -2.32 -0.06 0.00 -1.46 0.00 0.00 42.92 39.12 1p1d s ASP 114 CO 0.18 -1.01 1.35 0.54 0.52 0.00 0.00 175.17 176.76 1p1d s VAL 115 N 2.91 2.18 0.00 1.11 0.11 -1.26 -4.77 120.40 120.68 1p1d s VAL 115 Ca 0.17 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.36 1p1d s VAL 115 Cb -0.19 -3.07 0.00 0.00 -1.53 0.00 0.00 36.38 31.59 1p1d s VAL 115 CO 0.12 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.89 1p1d n ALA 116 N -0.81 -1.89 -1.90 1.54 0.00 0.38 -4.84 120.51 113.00 1p1d n ALA 116 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 1p1d n ALA 116 Cb 0.45 -0.32 -0.03 0.00 0.00 0.00 0.00 19.45 19.55 1p1d n ALA 116 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1p1d n GLU 117 N 0.81 0.00 0.00 0.00 0.28 -1.26 -4.89 120.64 115.59 1p1d n GLU 117 Ca 0.00 -0.42 0.00 0.00 -0.16 0.00 0.00 57.16 56.58 1p1d n GLU 117 Cb 0.00 0.24 0.00 0.00 1.43 0.00 0.00 31.44 33.11 1p1d n GLU 117 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1p1d n SER 118 N 0.00 0.00 -3.65 -1.84 2.88 -1.26 -4.96 113.62 104.79 1p1d n SER 118 Ca -0.12 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.23 1p1d n SER 118 Cb 0.54 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.83 1p1d n SER 118 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1p1d s VAL 119 N 0.00 -0.21 -0.49 2.46 1.01 -1.26 -4.49 120.40 117.43 1p1d s VAL 119 Ca 0.00 0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.32 1p1d s VAL 119 Cb 0.00 -0.32 0.19 0.00 0.00 0.00 0.00 36.38 36.26 1p1d s VAL 119 CO 0.00 0.08 0.65 0.00 0.00 0.00 0.00 175.10 175.83 1p1d n ILE 120 N 5.31 -0.30 -2.37 2.22 0.00 -0.86 -5.04 119.36 118.33 1p1d n ILE 120 Ca -0.04 -1.71 0.00 0.00 0.00 0.00 0.00 62.75 60.99 1p1d n ILE 120 Cb 0.50 0.35 0.00 0.00 0.00 0.00 0.00 39.64 40.48 1p1d n ILE 120 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1p1d n PRO 121 N 2.72 1.31 -1.10 9.51 -0.04 -1.26 -1.72 135.00 144.41 1p1d n PRO 121 Ca 0.20 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.65 1p1d n PRO 121 Cb 0.55 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.01 1p1d n PRO 121 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1p1d n SER 122 N -2.19 -0.13 -2.28 3.54 3.41 -0.95 -4.87 113.62 110.14 1p1d n SER 122 Ca 0.00 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 57.93 1p1d n SER 122 Cb 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1p1d n SER 122 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1p1d n SER 123 N -0.08 -9.26 0.00 4.04 7.64 -1.26 -4.48 113.62 110.21 1p1d n SER 123 Ca -0.02 1.73 0.00 0.00 1.01 0.00 0.00 58.87 61.59 1p1d n SER 123 Cb 0.42 -5.15 0.00 0.00 -1.01 0.00 0.00 64.21 58.47 1p1d n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p1d n GLY 124 N 1.90 2.78 2.65 0.23 0.00 -0.34 -4.91 105.19 107.51 1p1d n GLY 124 Ca 0.00 -0.18 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 1p1d n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1d s THR 125 N -1.81 0.30 -0.30 2.61 2.01 -1.25 -2.04 115.64 115.16 1p1d s THR 125 Ca 0.00 -0.70 -0.11 0.00 0.31 0.00 0.00 61.69 61.18 1p1d s THR 125 Cb 0.00 -1.05 -0.04 0.00 0.01 0.00 0.00 72.50 71.42 1p1d s THR 125 CO 0.00 -0.46 0.20 0.12 -0.69 0.00 0.00 174.62 173.78 1p1d s PHE 126 N 1.93 3.21 -0.04 4.92 2.19 0.13 -2.24 117.98 128.09 1p1d s PHE 126 Ca 0.05 -0.04 -0.08 0.00 0.33 0.00 0.00 56.93 57.18 1p1d s PHE 126 Cb -0.17 -2.40 -0.05 0.00 -1.31 0.00 0.00 43.02 39.10 1p1d s PHE 126 CO -0.20 -0.24 0.24 -1.01 1.83 0.00 0.00 175.22 175.84 1p1d s HIS 127 N 1.73 3.61 -0.35 10.12 3.76 -0.70 0.55 115.29 134.02 1p1d s HIS 127 Ca 0.07 0.62 0.00 0.00 -0.15 0.00 0.00 55.06 55.60 1p1d s HIS 127 Cb -0.16 -2.02 0.14 0.00 1.11 0.00 0.00 32.58 31.65 1p1d s HIS 127 CO 0.10 0.67 0.21 0.08 -0.85 0.00 0.00 174.74 174.95 1p1d s VAL 128 N -1.16 0.14 -0.75 -0.90 1.01 0.43 -2.02 120.40 117.14 1p1d s VAL 128 Ca 0.22 -1.71 -0.26 0.00 0.00 0.00 0.00 61.98 60.24 1p1d s VAL 128 Cb -0.13 -1.12 0.04 0.00 0.00 0.00 0.00 36.38 35.17 1p1d s VAL 128 CO 0.11 -0.99 1.24 -0.54 0.00 0.00 0.00 175.10 174.93 1p1d s LYS 129 N 1.08 3.22 -0.14 2.72 3.01 -1.26 -1.07 119.74 127.29 1p1d s LYS 129 Ca 0.18 -0.43 -0.01 0.00 -1.01 0.00 0.00 55.97 54.70 1p1d s LYS 129 Cb -0.23 -4.30 -0.02 0.00 -1.01 0.00 0.00 37.83 32.27 1p1d s LYS 129 CO 0.01 -2.10 -0.10 -0.51 0.51 0.00 0.00 175.35 173.16 1p1d s LEU 130 N 5.37 2.89 0.29 3.17 1.43 -0.80 -4.70 118.68 126.33 1p1d s LEU 130 Ca 0.34 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.88 1p1d s LEU 130 Cb -0.09 -1.67 -0.10 0.00 0.03 0.00 0.00 46.19 44.36 1p1d s LEU 130 CO 0.12 0.17 1.43 -2.16 0.23 0.00 0.00 176.35 176.13 1p1d s PRO 131 N 0.36 4.26 0.22 1.29 0.04 -1.26 -1.19 135.00 138.72 1p1d s PRO 131 Ca -0.09 2.34 0.05 0.00 0.04 0.00 0.00 61.00 63.34 1p1d s PRO 131 Cb -0.15 -3.08 -0.03 0.00 0.04 0.00 0.00 34.50 31.28 1p1d s PRO 131 CO 0.05 -0.39 0.32 0.15 0.04 0.00 0.00 177.00 177.16 1p1d s LYS 132 N -0.94 3.36 0.00 4.56 -0.14 -0.99 -4.83 119.74 120.77 1p1d s LYS 132 Ca 0.56 -0.77 0.00 0.00 -1.36 0.00 0.00 55.97 54.41 1p1d s LYS 132 Cb -0.42 -2.86 0.00 0.00 -1.68 0.00 0.00 37.83 32.87 1p1d s LYS 132 CO 0.48 0.45 0.00 1.63 -0.76 0.00 0.00 175.35 177.15 1p1d n LYS 133 N -1.17 2.84 -0.09 1.68 4.01 -1.26 -4.54 118.16 119.63 1p1d n LYS 133 Ca -0.08 0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.64 1p1d n LYS 133 Cb 0.56 0.00 -0.16 0.00 -0.51 0.00 0.00 35.03 34.93 1p1d n LYS 133 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 1p1d n HIS 134 N -0.09 0.00 -2.68 2.13 -0.00 -1.26 -4.77 115.22 108.54 1p1d n HIS 134 Ca 0.00 0.00 -0.06 0.00 0.46 0.00 0.00 57.72 58.12 1p1d n HIS 134 Cb 0.00 -0.93 0.09 0.00 -0.12 0.00 0.00 29.99 29.03 1p1d n HIS 134 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1p1d n SER 135 N -2.69 -1.65 -4.51 0.26 7.64 -1.26 -5.14 113.62 106.28 1p1d n SER 135 Ca -0.30 -2.22 -0.33 0.00 1.01 0.00 0.00 58.87 57.03 1p1d n SER 135 Cb 1.09 0.96 -0.12 0.00 -1.01 0.00 0.00 64.21 65.13 1p1d n SER 135 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1p1d s VAL 136 N 0.15 3.41 0.06 0.44 1.01 -1.26 -4.77 120.40 119.45 1p1d s VAL 136 Ca 0.16 -0.58 -0.31 0.00 0.00 0.00 0.00 61.98 61.26 1p1d s VAL 136 Cb 0.32 -2.39 -0.06 0.00 0.00 0.00 0.00 36.38 34.25 1p1d s VAL 136 CO -0.07 0.58 1.27 -1.83 0.00 0.00 0.00 175.10 175.04 1p1d s GLU 137 N -0.51 4.38 -0.04 2.72 -1.05 -1.26 -4.89 118.70 118.05 1p1d s GLU 137 Ca 0.07 1.87 -0.14 0.00 -0.15 0.00 0.00 54.97 56.62 1p1d s GLU 137 Cb -0.12 -3.35 -0.31 0.00 -0.44 0.00 0.00 34.13 29.91 1p1d s GLU 137 CO 0.02 -0.35 0.75 -0.07 0.95 0.00 0.00 175.26 176.56 1p1d h LEU 138 N 7.01 0.62 0.00 1.83 3.38 -1.96 -3.45 115.31 122.73 1p1d h LEU 138 Ca -0.41 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.64 1p1d h LEU 138 Cb 1.21 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1p1d h LEU 138 CO 0.84 1.70 0.00 0.61 0.09 0.00 0.00 178.44 181.68 1p1d n GLY 139 N 1.79 0.75 3.86 0.83 0.00 -1.26 -4.04 105.19 107.11 1p1d n GLY 139 Ca -0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 1p1d n GLY 139 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 140 N -2.20 4.84 -0.10 -0.61 -4.36 -1.26 0.53 121.20 118.05 1p1d s ILE 140 Ca 0.00 0.69 0.02 0.00 -0.26 0.00 0.00 60.65 61.09 1p1d s ILE 140 Cb 0.00 -3.64 0.01 0.00 1.25 0.00 0.00 42.46 40.08 1p1d s ILE 140 CO 0.00 -0.04 -0.14 -0.89 0.24 0.00 0.00 174.94 174.11 1p1d s THR 141 N -1.79 1.39 0.56 8.37 2.01 0.42 -4.93 115.64 121.68 1p1d s THR 141 Ca 0.47 -0.58 -0.05 0.00 0.31 0.00 0.00 61.69 61.84 1p1d s THR 141 Cb -0.12 -1.28 0.00 0.00 0.01 0.00 0.00 72.50 71.12 1p1d s THR 141 CO 0.20 0.42 0.86 -0.63 -0.69 0.00 0.00 174.62 174.77 1p1d s ILE 142 N 0.95 3.85 0.14 1.82 1.01 -1.26 0.00 121.20 127.71 1p1d s ILE 142 Ca -0.08 -0.04 -0.25 0.00 0.00 0.00 0.00 60.65 60.29 1p1d s ILE 142 Cb -0.15 -3.50 0.07 0.00 0.01 0.00 0.00 42.46 38.88 1p1d s ILE 142 CO -0.01 -0.49 0.79 -0.94 0.00 0.00 0.00 174.94 174.29 1p1d s SER 143 N -4.27 -0.35 -0.22 3.58 1.04 0.11 -4.63 113.70 108.97 1p1d s SER 143 Ca 0.52 -0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.70 1p1d s SER 143 Cb -0.10 0.55 0.06 0.00 0.10 0.00 0.00 66.02 66.62 1p1d s SER 143 CO 0.44 -0.95 -0.01 -0.44 0.98 0.00 0.00 173.24 173.26 1p1d s SER 144 N -2.77 3.41 0.28 7.02 0.01 -1.26 -1.76 113.70 118.64 1p1d s SER 144 Ca 0.07 -1.02 -0.01 0.00 1.31 0.00 0.00 55.95 56.31 1p1d s SER 144 Cb -0.02 -0.90 0.48 0.00 0.21 0.00 0.00 66.02 65.78 1p1d s SER 144 CO -0.04 -0.27 1.89 -0.65 0.41 0.00 0.00 173.24 174.59 1p1d h PRO 145 N 8.09 1.06 -4.67 12.44 0.11 -1.95 -3.48 132.00 143.61 1p1d h PRO 145 Ca -0.17 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1p1d h PRO 145 Cb 1.09 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1p1d h PRO 145 CO 0.38 0.70 -0.73 0.45 -0.21 0.00 0.00 178.00 178.59 1p1d n SER 146 N -4.50 -6.69 -1.64 -2.05 2.88 -1.26 -4.93 113.62 95.43 1p1d n SER 146 Ca 0.15 1.04 0.09 0.00 -1.33 0.00 0.00 58.87 58.81 1p1d n SER 146 Cb 0.20 -4.39 0.36 0.00 -0.75 0.00 0.00 64.21 59.64 1p1d n SER 146 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1p1d n SER 147 N 0.44 4.89 -3.63 -3.46 2.88 -1.26 -4.95 113.62 108.53 1p1d n SER 147 Ca 0.01 -2.55 -0.24 0.00 -1.33 0.00 0.00 58.87 54.77 1p1d n SER 147 Cb 0.04 -0.60 0.04 0.00 -0.75 0.00 0.00 64.21 62.94 1p1d n SER 147 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1p1d n ARG 148 N 0.99 -3.31 -3.78 -1.46 3.00 -1.26 -5.00 116.66 105.84 1p1d n ARG 148 Ca 0.26 0.60 -0.11 0.00 -0.01 0.00 0.00 57.85 58.59 1p1d n ARG 148 Cb 0.95 -4.94 -0.07 0.00 0.00 0.00 0.00 32.46 28.40 1p1d n ARG 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1p1d s LYS 149 N -5.75 0.80 -1.03 5.56 0.00 -1.26 -5.07 119.74 112.99 1p1d s LYS 149 Ca 0.22 -0.58 -0.26 0.00 0.00 0.00 0.00 55.97 55.34 1p1d s LYS 149 Cb -0.06 0.34 -0.19 0.00 0.00 0.00 0.00 37.83 37.93 1p1d s LYS 149 CO 0.82 -0.26 2.15 -1.25 0.00 0.00 0.00 175.35 176.81 1p1d s PRO 150 N -2.75 1.45 0.00 1.78 0.04 -1.26 -3.74 135.00 130.52 1p1d s PRO 150 Ca -0.04 -0.32 0.00 0.00 0.04 0.00 0.00 61.00 60.69 1p1d s PRO 150 Cb -0.00 -4.97 0.00 0.00 0.04 0.00 0.00 34.50 29.57 1p1d s PRO 150 CO -0.05 -5.06 0.00 0.41 0.04 0.00 0.00 177.00 172.34 1p1d n GLY 151 N 6.28 -2.12 2.90 0.56 0.00 -1.26 -5.09 105.19 106.46 1p1d n GLY 151 Ca 0.43 0.71 -0.06 0.00 0.00 0.00 0.00 46.02 47.09 1p1d n GLY 151 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p1d n ASP 152 N 0.00 -7.93 -2.72 1.61 2.03 -1.25 -4.88 116.55 103.40 1p1d n ASP 152 Ca 0.00 0.40 -0.08 0.00 0.52 0.00 0.00 54.79 55.64 1p1d n ASP 152 Cb 0.00 -5.39 0.06 0.00 -0.72 0.00 0.00 41.12 35.07 1p1d n ASP 152 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1p1d n PRO 153 N -0.63 -1.34 -4.11 -0.67 -0.04 -1.26 -4.61 135.00 122.33 1p1d n PRO 153 Ca 0.09 -0.46 -0.30 0.00 -0.04 0.00 0.00 63.50 62.80 1p1d n PRO 153 Cb 0.47 -0.41 -0.07 0.00 -0.04 0.00 0.00 33.50 33.45 1p1d n PRO 153 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1p1d s LEU 154 N 0.00 3.59 -0.07 1.53 2.01 -1.25 -4.63 118.68 119.85 1p1d s LEU 154 Ca 0.18 -0.14 -0.15 0.00 0.01 0.00 0.00 54.13 54.03 1p1d s LEU 154 Cb -0.02 -2.28 0.03 0.00 0.01 0.00 0.00 46.19 43.93 1p1d s LEU 154 CO 0.14 0.16 0.36 0.68 1.01 0.00 0.00 176.35 178.70 1p1d s VAL 155 N -1.41 0.03 0.33 -1.59 -7.23 -0.72 0.67 120.40 110.47 1p1d s VAL 155 Ca 0.27 -0.24 -0.26 0.00 -1.81 0.00 0.00 61.98 59.94 1p1d s VAL 155 Cb -0.11 -0.60 -0.10 0.00 0.56 0.00 0.00 36.38 36.12 1p1d s VAL 155 CO 0.20 -0.13 0.98 -0.63 -0.31 0.00 0.00 175.10 175.21 1p1d s ILE 156 N -0.67 4.01 0.00 -0.62 1.09 -1.26 0.09 121.20 123.84 1p1d s ILE 156 Ca -0.08 1.70 0.00 0.00 -1.10 0.00 0.00 60.65 61.17 1p1d s ILE 156 Cb -0.04 -3.96 0.00 0.00 -1.06 0.00 0.00 42.46 37.41 1p1d s ILE 156 CO 0.03 0.16 0.00 -0.24 -0.10 0.00 0.00 174.94 174.79 1p1d n SER 157 N 0.56 0.38 -3.61 3.58 2.88 0.10 -3.07 113.62 114.44 1p1d n SER 157 Ca 0.02 -0.23 -0.13 0.00 -1.33 0.00 0.00 58.87 57.20 1p1d n SER 157 Cb 0.49 0.54 -0.07 0.00 -0.75 0.00 0.00 64.21 64.42 1p1d n SER 157 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1p1d s ASP 158 N -0.61 -0.63 0.04 -3.46 2.15 -1.21 -4.96 116.67 107.99 1p1d s ASP 158 Ca 0.00 1.11 0.02 0.00 0.43 0.00 0.00 52.55 54.11 1p1d s ASP 158 Cb 0.00 1.08 -0.02 0.00 -0.30 0.00 0.00 42.92 43.68 1p1d s ASP 158 CO 0.00 -0.29 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.01 1p1d s ILE 159 N -0.02 0.51 0.46 4.11 1.01 -1.23 0.16 121.20 126.20 1p1d s ILE 159 Ca -0.01 -1.02 0.06 0.00 0.00 0.00 0.00 60.65 59.68 1p1d s ILE 159 Cb -0.04 -0.57 -0.03 0.00 0.01 0.00 0.00 42.46 41.83 1p1d s ILE 159 CO 0.01 -0.36 0.18 -0.75 0.00 0.00 0.00 174.94 174.01 1p1d s LYS 160 N -1.48 2.20 0.04 2.79 2.20 0.19 -4.91 119.74 120.77 1p1d s LYS 160 Ca -0.10 -2.01 0.07 0.00 -0.36 0.00 0.00 55.97 53.57 1p1d s LYS 160 Cb -0.09 -1.89 -0.03 0.00 -1.51 0.00 0.00 37.83 34.30 1p1d s LYS 160 CO 0.00 -0.25 -0.16 0.15 -0.36 0.00 0.00 175.35 174.73 1p1d s LYS 161 N -3.96 2.13 0.00 4.03 1.02 -1.26 -4.30 119.74 117.39 1p1d s LYS 161 Ca 0.33 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.36 1p1d s LYS 161 Cb 0.03 -2.24 0.00 0.00 -0.52 0.00 0.00 37.83 35.10 1p1d s LYS 161 CO 0.18 0.54 0.00 0.41 -0.92 0.00 0.00 175.35 175.56 1p1d n GLY 162 N 1.44 1.87 3.76 -3.33 0.00 -1.26 -4.82 105.19 102.86 1p1d n GLY 162 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 1p1d n GLY 162 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p1d s SER 163 N -1.25 5.19 0.64 1.61 1.04 -1.26 -4.69 113.70 114.98 1p1d s SER 163 Ca 0.00 -0.37 0.39 0.00 0.48 0.00 0.00 55.95 56.45 1p1d s SER 163 Cb 0.00 -1.22 2.19 0.00 0.10 0.00 0.00 66.02 67.10 1p1d s SER 163 CO 0.00 -0.02 2.32 -0.37 0.98 0.00 0.00 173.24 176.16 1p1d h VAL 164 N 1.68 0.19 -0.27 5.02 -1.51 -1.91 -3.08 116.25 116.37 1p1d h VAL 164 Ca -0.47 -0.03 0.03 0.00 -1.23 0.00 0.00 66.70 65.00 1p1d h VAL 164 Cb 1.24 1.02 -0.04 0.00 -2.13 0.00 0.00 31.29 31.38 1p1d h VAL 164 CO 0.61 0.00 -0.26 0.00 -1.23 0.00 0.00 177.57 176.69 1p1d h ALA 165 N 2.00 -0.43 0.00 5.19 0.00 -1.92 -0.25 119.26 123.84 1p1d h ALA 165 Ca -0.00 0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.69 1p1d h ALA 165 Cb 0.02 0.99 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1p1d h ALA 165 CO 0.00 -0.58 -1.24 1.25 0.00 0.00 0.00 179.25 178.69 1p1d h HIS 166 N -0.12 0.00 -0.94 0.00 6.17 -1.74 -3.34 115.15 115.17 1p1d h HIS 166 Ca 0.05 0.00 0.07 0.00 0.71 0.00 0.00 60.37 61.20 1p1d h HIS 166 Cb 0.24 0.00 -0.07 0.00 2.52 0.00 0.00 27.41 30.11 1p1d h HIS 166 CO -0.76 0.99 0.60 0.00 0.71 0.00 0.00 177.93 179.47 1p1d h ARG 167 N 0.00 1.03 -1.37 5.26 -0.00 -1.41 -1.74 114.38 116.15 1p1d h ARG 167 Ca -0.10 -0.06 0.40 0.00 -0.50 0.00 0.00 59.98 59.71 1p1d h ARG 167 Cb 1.85 -0.23 -0.05 0.00 0.00 0.00 0.00 29.97 31.53 1p1d h ARG 167 CO 0.11 0.68 1.05 0.00 0.00 0.00 0.00 179.97 181.81 1p1d h THR 168 N 1.06 0.23 -3.95 2.04 1.03 -1.16 1.11 112.91 113.27 1p1d h THR 168 Ca 0.42 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.80 1p1d h THR 168 Cb 0.21 0.25 0.01 0.00 -1.07 0.00 0.00 68.15 67.56 1p1d h THR 168 CO -0.19 0.00 -0.05 0.61 -0.01 0.00 0.00 175.52 175.88 1p1d n GLY 169 N -1.80 -0.57 0.00 2.99 0.00 -0.66 -4.10 105.19 101.06 1p1d n GLY 169 Ca 0.30 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1p1d n GLY 169 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1p1d n THR 170 N -1.43 0.00 -1.44 2.61 5.66 -1.26 -4.95 114.28 113.46 1p1d n THR 170 Ca -0.00 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.59 1p1d n THR 170 Cb 0.51 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.24 1p1d n THR 170 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1p1d n LEU 171 N -0.50 4.25 -4.93 1.09 4.77 -1.26 -4.91 117.00 115.51 1p1d n LEU 171 Ca 0.00 -3.13 -0.28 0.00 -0.03 0.00 0.00 56.01 52.57 1p1d n LEU 171 Cb 0.00 -1.32 -0.03 0.00 -2.33 0.00 0.00 43.42 39.74 1p1d n LEU 171 CO 0.00 -0.44 -0.12 -1.83 -1.33 0.00 0.00 177.39 173.67 1p1d s GLU 172 N 5.03 3.44 0.02 3.23 -1.05 -1.26 -4.82 118.70 123.29 1p1d s GLU 172 Ca 0.58 -0.53 -0.30 0.00 -0.15 0.00 0.00 54.97 54.57 1p1d s GLU 172 Cb 0.11 -3.00 -0.04 0.00 -0.44 0.00 0.00 34.13 30.76 1p1d s GLU 172 CO 0.10 0.56 1.12 -0.48 0.95 0.00 0.00 175.26 177.51 1p1d s LEU 173 N -2.92 4.36 0.00 1.83 2.34 -1.26 -3.91 118.68 119.12 1p1d s LEU 173 Ca 0.35 1.86 0.00 0.00 0.06 0.00 0.00 54.13 56.39 1p1d s LEU 173 Cb -0.12 -3.57 0.00 0.00 -0.56 0.00 0.00 46.19 41.94 1p1d s LEU 173 CO 0.28 -0.41 0.00 0.61 -1.06 0.00 0.00 176.35 175.77 1p1d n GLY 174 N 3.12 1.76 1.67 -3.48 0.00 -1.17 -5.01 105.19 102.09 1p1d n GLY 174 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1p1d n GLY 174 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p1d n ASP 175 N 0.00 2.09 -3.76 1.61 -0.08 -1.25 -5.05 116.55 110.10 1p1d n ASP 175 Ca 0.00 -1.90 -0.29 0.00 -1.51 0.00 0.00 54.79 51.09 1p1d n ASP 175 Cb 0.00 0.05 -0.16 0.00 2.34 0.00 0.00 41.12 43.35 1p1d n ASP 175 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1p1d s LYS 176 N -2.94 0.82 0.65 -0.67 2.47 -1.25 -4.51 119.74 114.31 1p1d s LYS 176 Ca 0.09 -0.71 -0.13 0.00 -1.56 0.00 0.00 55.97 53.65 1p1d s LYS 176 Cb -0.01 -2.13 -0.01 0.00 -1.46 0.00 0.00 37.83 34.22 1p1d s LYS 176 CO 0.06 -0.75 1.06 -0.51 0.16 0.00 0.00 175.35 175.37 1p1d s LEU 177 N 1.72 3.30 0.00 5.43 1.43 0.21 0.11 118.68 130.88 1p1d s LEU 177 Ca 0.02 1.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.85 1p1d s LEU 177 Cb -0.17 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.53 1p1d s LEU 177 CO -0.13 -1.37 0.00 -0.11 0.23 0.00 0.00 176.35 174.97 1p1d n LEU 178 N -2.63 0.02 -4.26 1.79 0.00 -0.48 -3.85 117.00 107.58 1p1d n LEU 178 Ca 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 56.01 55.93 1p1d n LEU 178 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.85 1p1d n LEU 178 CO 0.51 -0.38 -0.43 0.00 0.00 0.00 0.00 177.39 177.09 1p1d s ALA 179 N -1.97 1.56 -0.23 1.96 0.00 -1.15 0.07 121.76 122.00 1p1d s ALA 179 Ca 0.00 -1.42 -0.04 0.00 0.00 0.00 0.00 51.96 50.50 1p1d s ALA 179 Cb 0.00 -0.03 0.08 0.00 0.00 0.00 0.00 23.12 23.17 1p1d s ALA 179 CO 0.00 0.02 0.10 0.42 0.00 0.00 0.00 175.76 176.30 1p1d s ILE 180 N -2.71 0.03 0.00 0.00 1.01 0.17 -1.65 121.20 118.05 1p1d s ILE 180 Ca 0.14 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.29 1p1d s ILE 180 Cb -0.02 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.62 1p1d s ILE 180 CO 0.03 -0.46 0.00 -0.67 0.00 0.00 0.00 174.94 173.83 1p1d n ASP 181 N 5.22 0.00 0.00 3.58 2.03 0.51 -1.16 116.55 126.73 1p1d n ASP 181 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 1p1d n ASP 181 Cb 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 1p1d n ASP 181 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1p1d n ASN 182 N 1.38 2.06 -4.83 1.67 3.02 -1.26 -4.84 115.26 112.45 1p1d n ASN 182 Ca 0.00 -0.03 -0.37 0.00 -0.03 0.00 0.00 54.58 54.15 1p1d n ASN 182 Cb 0.00 0.48 -0.06 0.00 -0.61 0.00 0.00 39.78 39.59 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1p1d s ILE 183 N -0.89 5.30 -0.21 2.41 -1.09 -0.31 -5.08 121.20 121.33 1p1d s ILE 183 Ca 0.00 0.49 -0.07 0.00 -2.23 0.00 0.00 60.65 58.84 1p1d s ILE 183 Cb 0.00 -3.55 -0.03 0.00 -1.58 0.00 0.00 42.46 37.30 1p1d s ILE 183 CO 0.00 0.56 0.05 -0.13 -1.23 0.00 0.00 174.94 174.19 1p1d s ARG 184 N -0.76 3.76 0.00 2.79 0.52 -1.26 0.44 118.95 124.43 1p1d s ARG 184 Ca 0.18 -0.44 0.19 0.00 -0.52 0.00 0.00 55.73 55.14 1p1d s ARG 184 Cb -0.14 -3.22 0.90 0.00 0.52 0.00 0.00 34.95 33.01 1p1d s ARG 184 CO 0.07 0.02 1.59 1.28 0.02 0.00 0.00 175.30 178.28 1p1d n LEU 185 N 4.28 0.00 -0.47 2.53 7.99 0.11 -3.53 117.00 127.91 1p1d n LEU 185 Ca -0.16 0.36 0.41 0.00 -0.01 0.00 0.00 56.01 56.61 1p1d n LEU 185 Cb 0.52 -0.36 0.75 0.00 -0.11 0.00 0.00 43.42 44.21 1p1d n LEU 185 CO 0.33 -0.13 1.36 -0.78 -1.51 0.00 0.00 177.39 176.66 1p1d h ASP 186 N 0.00 0.06 0.00 -1.43 3.58 -1.92 -1.62 116.42 115.09 1p1d h ASP 186 Ca 0.00 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.47 1p1d h ASP 186 Cb 0.23 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.30 1p1d h ASP 186 CO 0.00 -0.01 -0.21 -1.54 -2.88 0.00 0.00 179.24 174.60 1p1d n SER 187 N -4.19 1.03 -2.14 2.28 3.41 -1.23 -4.86 113.62 107.93 1p1d n SER 187 Ca 0.33 -0.28 -0.02 0.00 -0.26 0.00 0.00 58.87 58.65 1p1d n SER 187 Cb 1.50 0.76 0.01 0.00 -0.26 0.00 0.00 64.21 66.22 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1p1d n SER 189 N -3.04 2.62 0.23 0.00 7.64 -1.26 -4.91 113.62 114.89 1p1d n SER 189 Ca 0.01 -2.29 -0.13 0.00 1.01 0.00 0.00 58.87 57.47 1p1d n SER 189 Cb 0.04 0.14 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 1p1d n SER 189 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1p1d h MET 190 N 0.00 -0.60 -0.87 1.43 4.05 -1.89 -2.29 114.93 114.76 1p1d h MET 190 Ca -0.24 0.04 0.11 0.00 -0.28 0.00 0.00 59.70 59.33 1p1d h MET 190 Cb 0.77 0.14 -0.08 0.00 -0.80 0.00 0.00 31.60 31.63 1p1d h MET 190 CO 0.40 -0.30 0.51 0.93 0.23 0.00 0.00 176.91 178.68 1p1d h GLU 191 N -1.00 0.80 -0.61 0.39 4.39 -1.99 -0.62 114.58 115.94 1p1d h GLU 191 Ca -0.06 -0.05 0.07 0.00 0.34 0.00 0.00 59.36 59.66 1p1d h GLU 191 Cb 0.58 -0.18 -0.06 0.00 -0.10 0.00 0.00 28.75 28.99 1p1d h GLU 191 CO 0.10 0.53 0.29 0.22 -1.16 0.00 0.00 179.01 178.99 1p1d h ASP 192 N 0.82 0.38 -0.83 1.42 3.58 -1.96 -0.87 116.42 118.97 1p1d h ASP 192 Ca 0.43 0.05 0.06 0.00 0.42 0.00 0.00 57.03 57.99 1p1d h ASP 192 Cb 0.43 -0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.40 1p1d h ASP 192 CO -0.27 0.24 0.51 0.00 -2.88 0.00 0.00 179.24 176.85 1p1d h ALA 193 N 1.36 1.13 -0.71 -0.78 0.00 -0.52 -0.09 119.26 119.65 1p1d h ALA 193 Ca 0.29 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1p1d h ALA 193 Cb 0.26 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1p1d h ALA 193 CO -0.22 0.26 0.47 0.28 0.00 0.00 0.00 179.25 180.04 1p1d h VAL 194 N 0.95 1.12 0.03 0.00 2.07 -0.69 0.49 116.25 120.23 1p1d h VAL 194 Ca 0.36 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1p1d h VAL 194 Cb 0.15 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 1p1d h VAL 194 CO -0.16 0.16 -0.02 1.56 0.02 0.00 0.00 177.57 179.13 1p1d h GLN 195 N 0.88 -0.05 0.00 1.57 1.08 -0.24 -1.34 115.11 117.02 1p1d h GLN 195 Ca 0.28 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.43 1p1d h GLN 195 Cb 0.02 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 1p1d h GLN 195 CO -0.07 0.01 -0.23 0.82 -0.95 0.00 0.00 178.83 178.40 1p1d h ILE 196 N -0.09 0.72 -0.15 2.54 1.08 -0.69 -0.35 117.51 120.57 1p1d h ILE 196 Ca -0.00 -0.98 -0.06 0.00 -0.39 0.00 0.00 64.86 63.43 1p1d h ILE 196 Cb 0.08 1.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.43 1p1d h ILE 196 CO 0.01 0.23 -0.16 0.25 -0.69 0.00 0.00 178.15 177.78 1p1d h LEU 197 N 0.00 0.23 0.05 1.44 5.85 0.10 0.67 115.31 123.65 1p1d h LEU 197 Ca -0.00 -0.05 -0.38 0.00 0.84 0.00 0.00 57.88 58.29 1p1d h LEU 197 Cb 0.60 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 1p1d h LEU 197 CO 0.03 0.42 -2.21 0.00 -0.34 0.00 0.00 178.44 176.33 1p1d n GLN 198 N -4.24 0.68 -0.15 1.25 6.02 -0.67 -4.20 117.38 116.07 1p1d n GLN 198 Ca -0.01 0.23 0.03 0.00 -0.01 0.00 0.00 57.00 57.24 1p1d n GLN 198 Cb 0.29 -1.61 0.09 0.00 1.02 0.00 0.00 30.24 30.04 1p1d n GLN 198 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p1d n GLN 199 N -3.51 1.66 -0.03 -1.09 -0.00 -0.18 -4.48 117.38 109.75 1p1d n GLN 199 Ca -0.40 -0.73 0.00 0.00 -0.00 0.00 0.00 57.00 55.87 1p1d n GLN 199 Cb 0.99 -1.37 0.00 0.00 -0.00 0.00 0.00 30.24 29.86 1p1d n GLN 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p1d n GLU 201 N 1.08 -1.14 -3.38 0.00 -0.58 -1.26 -0.20 120.64 115.16 1p1d n GLU 201 Ca 0.00 0.55 -0.20 0.00 -0.42 0.00 0.00 57.16 57.09 1p1d n GLU 201 Cb 0.14 -1.61 -0.03 0.00 -0.57 0.00 0.00 31.44 29.37 1p1d n GLU 201 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1p1d n ASP 202 N -1.75 -2.06 -3.15 1.62 9.92 -1.26 -4.83 116.55 115.03 1p1d n ASP 202 Ca -0.24 -0.30 0.05 0.00 -0.53 0.00 0.00 54.79 53.78 1p1d n ASP 202 Cb 0.51 -1.80 -0.01 0.00 -0.64 0.00 0.00 41.12 39.18 1p1d n ASP 202 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1p1d s LEU 203 N -6.12 -0.65 -0.37 0.64 0.20 0.72 -2.34 118.68 110.76 1p1d s LEU 203 Ca 0.37 0.19 -0.08 0.00 0.69 0.00 0.00 54.13 55.30 1p1d s LEU 203 Cb -0.21 1.46 0.05 0.00 -0.43 0.00 0.00 46.19 47.06 1p1d s LEU 203 CO 0.46 -0.12 0.17 -0.69 -0.29 0.00 0.00 176.35 175.87 1p1d s VAL 204 N 2.93 4.05 -0.47 1.68 1.01 -0.33 -4.73 120.40 124.54 1p1d s VAL 204 Ca 0.15 -1.16 -0.19 0.00 0.00 0.00 0.00 61.98 60.78 1p1d s VAL 204 Cb -0.06 -3.34 0.04 0.00 0.00 0.00 0.00 36.38 33.01 1p1d s VAL 204 CO -0.19 -0.28 0.60 -0.75 0.00 0.00 0.00 175.10 174.47 1p1d s LYS 205 N 1.43 3.16 -0.50 2.72 2.20 -1.26 -1.90 119.74 125.59 1p1d s LYS 205 Ca 0.00 -0.73 -0.23 0.00 -0.36 0.00 0.00 55.97 54.66 1p1d s LYS 205 Cb -0.20 -4.04 0.04 0.00 -1.51 0.00 0.00 37.83 32.12 1p1d s LYS 205 CO 0.03 -1.10 0.81 -0.51 -0.36 0.00 0.00 175.35 174.22 1p1d s LEU 206 N 2.60 4.34 -0.73 5.43 1.02 -0.23 -0.36 118.68 130.74 1p1d s LEU 206 Ca 0.17 -0.36 -0.13 0.00 0.02 0.00 0.00 54.13 53.82 1p1d s LEU 206 Cb -0.17 -2.81 0.19 0.00 0.02 0.00 0.00 46.19 43.42 1p1d s LEU 206 CO 0.14 -1.02 0.66 -0.54 0.02 0.00 0.00 176.35 175.61 1p1d s LYS 207 N 3.40 3.33 0.60 1.70 1.02 -0.66 -0.43 119.74 128.70 1p1d s LYS 207 Ca 0.27 -2.28 -0.05 0.00 0.02 0.00 0.00 55.97 53.93 1p1d s LYS 207 Cb -0.14 -4.32 0.02 0.00 -0.52 0.00 0.00 37.83 32.88 1p1d s LYS 207 CO 0.19 -1.28 0.89 0.42 -0.92 0.00 0.00 175.35 174.65 1p1d s ILE 208 N 0.50 3.31 -0.19 2.17 1.09 0.19 -1.39 121.20 126.87 1p1d s ILE 208 Ca 0.14 -0.16 -0.03 0.00 -1.10 0.00 0.00 60.65 59.50 1p1d s ILE 208 Cb -0.16 -3.32 -0.01 0.00 -1.06 0.00 0.00 42.46 37.91 1p1d s ILE 208 CO -0.06 -0.31 -0.06 -0.13 -0.10 0.00 0.00 174.94 174.28 1p1d s ARG 209 N -4.99 3.43 -0.48 2.79 0.52 0.30 0.17 118.95 120.70 1p1d s ARG 209 Ca 0.55 -0.62 -0.00 0.00 -0.52 0.00 0.00 55.73 55.14 1p1d s ARG 209 Cb -0.10 -2.93 0.13 0.00 0.52 0.00 0.00 34.95 32.56 1p1d s ARG 209 CO 0.44 -0.05 0.26 0.15 0.02 0.00 0.00 175.30 176.11 1p1d s LYS 210 N 1.10 2.07 -0.29 3.54 -0.14 -0.87 -3.97 119.74 121.19 1p1d s LYS 210 Ca 0.01 -2.21 -0.04 0.00 -1.36 0.00 0.00 55.97 52.37 1p1d s LYS 210 Cb -0.15 -3.51 0.00 0.00 -1.68 0.00 0.00 37.83 32.50 1p1d s LYS 210 CO -0.01 -1.09 2.81 -3.47 -0.76 0.00 0.00 175.35 172.84 1p1d n ASP 211 N 3.89 6.10 -3.01 2.83 -0.08 -1.26 -1.20 116.55 123.82 1p1d n ASP 211 Ca 0.03 -2.96 0.00 0.00 -1.51 0.00 0.00 54.79 50.36 1p1d n ASP 211 Cb 0.39 -1.24 0.00 0.00 2.34 0.00 0.00 41.12 42.60 1p1d n ASP 211 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1p1d n GLU 212 N 1.22 -1.33 0.00 -0.67 0.28 -1.26 -5.08 120.64 113.80 1p1d n GLU 212 Ca 0.41 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.41 1p1d n GLU 212 Cb 0.64 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.51 1p1d n GLU 212 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72